Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 1,4-Bis(glutathion-S-yl)-1,2,3,4-tetrachlorobuta-1,3-diene
RN: 117707-49-0
InChIKey: CPQIOCSSYOKBQY-FYXRKLMBSA-N

Molecular Formula

  • C24-H32-Cl4-N6-O12-S2

Molecular Weight

  • 802.4908
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Name of Substance

  • 1,4-Bis(glutathion-S-yl)-1,2,3,4-tetrachlorobuta-1,3-diene

Synonym

  • BGTCB

Systematic Name

  • Glycine, 2,2'-(1,2,3,4-tetrachloro-1,3-butadiene-1,4-diyl)bis(L-gamma-glutamyl-L-cysteinyl-, (E,E)-

Registry Numbers

CAS Registry Number

  • 117707-49-0

System Generated Number

  • 0117707490

Structure Descriptors

InChI

1S/C24H32Cl4N6O12S2/c25-15(17(27)23(7-47,21(45)31-5-13(37)38)33-11(35)3-1-9(29)19(41)42)16(26)18(28)24(8-48,22(46)32-6-14(39)40)34-12(36)4-2-10(30)20(43)44/h9-10,47-48H,1-8,29-30H2,(H,31,45)(H,32,46)(H,33,35)(H,34,36)(H,37,38)(H,39,40)(H,41,42)(H,43,44)/b17-15+,18-16+/t9-,10-,23-,24-/m0/s1

InChIKey

CPQIOCSSYOKBQY-FYXRKLMBSA-N

Smiles

C([C@H](N)C(=O)O)CC(=O)N[C@](C(=O)NCC(=O)O)(/C(=C(\Cl)/C(=C(\Cl)/[C@](NC(=O)CC[C@H](N)C(=O)O)(C(=O)NCC(=O)O)CS)/Cl)/Cl)CS